5-ethyl-6-methyl-2-(oxolan-2-yl)pyrimidin-4-amine

C11H17N3O — CID 65328606

IUPAC5-ethyl-6-methyl-2-(oxolan-2-yl)pyrimidin-4-amine
SMILESCCc1c(C)nc(C2CCCO2)nc1N
InChIInChI=1S/C11H17N3O/c1-3-8-7(2)13-11(14-10(8)12)9-5-4-6-15-9/h9H,3-6H2,1-2H3,(H2,12,13,14)
InChIKeyQFEONRLVWJXNDK-UHFFFAOYSA-N
MW207.28 g/mol
LogP1.78
Rot. Bonds2

About 5-ethyl-6-methyl-2-(oxolan-2-yl)pyrimidin-4-amine

5-ethyl-6-methyl-2-(oxolan-2-yl)pyrimidin-4-amine (PubChem CID 65328606) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is 5-ethyl-6-methyl-2-(oxolan-2-yl)pyrimidin-4-amine.

Molecular Properties

Compound Name5-ethyl-6-methyl-2-(oxolan-2-yl)pyrimidin-4-amine
PubChem CID65328606
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Name5-ethyl-6-methyl-2-(oxolan-2-yl)pyrimidin-4-amine
SMILESCCc1c(C)nc(C2CCCO2)nc1N
InChIInChI=1S/C11H17N3O/c1-3-8-7(2)13-11(14-10(8)12)9-5-4-6-15-9/h9H,3-6H2,1-2H3,(H2,12,13,14)
InChIKeyQFEONRLVWJXNDK-UHFFFAOYSA-N
XLogP1.78
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-6-methyl-2-(oxolan-2-yl)pyrimidin-4-amine?
The IUPAC name of 5-ethyl-6-methyl-2-(oxolan-2-yl)pyrimidin-4-amine (CID 65328606) is 5-ethyl-6-methyl-2-(oxolan-2-yl)pyrimidin-4-amine.
What is the SMILES notation for 5-ethyl-6-methyl-2-(oxolan-2-yl)pyrimidin-4-amine?
The canonical SMILES for 5-ethyl-6-methyl-2-(oxolan-2-yl)pyrimidin-4-amine is CCc1c(C)nc(C2CCCO2)nc1N.
What is the InChIKey of 5-ethyl-6-methyl-2-(oxolan-2-yl)pyrimidin-4-amine?
The InChIKey is QFEONRLVWJXNDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c1-3-8-7(2)13-11(14-10(8)12)9-5-4-6-15-9/h9H,3-6H2,1-2H3,(H2,12,13,14).
What are the key properties of 5-ethyl-6-methyl-2-(oxolan-2-yl)pyrimidin-4-amine?
5-ethyl-6-methyl-2-(oxolan-2-yl)pyrimidin-4-amine has a molecular weight of 207.28 g/mol, XLogP of 1.78, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-6-methyl-2-(oxolan-2-yl)pyrimidin-4-amine is sourced from PubChem (CID 65328606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).